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(5-methyl-1,3,4-oxadiazol-2-yl)methyl 5-nitro-1-benzothiophene-2-carboxylate

(5-methyl-1,3,4-oxadiazol-2-yl)methyl 5-nitro-1-benzothiophene-2-carboxylate

Systemtic Name:(5-methyl-1,3,4-oxadiazol-2-yl)methyl 5-nitro-1-benzothiophene-2-carboxylate
Openeye Name:(5-methyl-1,3,4-oxadiazol-2-yl)methyl 5-nitrobenzothiophene-2-carboxylate
CAS Name:5-nitro-1-benzothiophene-2-carboxylic acid (5-methyl-1,3,4-oxadiazol-2-yl)methyl ester
IUPAC Name:(5-methyl-1,3,4-oxadiazol-2-yl)methyl 5-nitro-1-benzothiophene-2-carboxylate
Traditional Name:5-nitrobenzothiophene-2-carboxylic acid (5-methyl-1,3,4-oxadiazol-2-yl)methyl ester
Formula: C13H9N3O5S
MolecularWeight: 319.29266
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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(O1)COC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]


Isomeric SMILES

CC1=NN=C(O1)COC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]


InChI

InChI=1S/C13H9N3O5S/c1-7-14-15-12(21-7)6-20-13(17)11-5-8-4-9(16(18)19)2-3-10(8)22-11/h2-5H,6H2,1H3


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